CAS RN: 28130-13-4
H-VAL-VAL-VAL-OH
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250314 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS28130-13-4
- Purity/Analytical Methods: >99.0%
28130-13-4 / 2-[[2-[(2-amino-3-methylbutanoyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid
Basic Information
CAS
28130-13-4
Multi CAS
Yes
Molecular Formula
C15H29N3O4
Molecular Weight
315.410000
Exact Mass
315.215806
InChI
InChI=1S/C15H29N3O4/c1-7(2)10(16)13(19)17-11(8(3)4)14(20)18-12(9(5)6)15(21)22/h7-12H,16H2,1-6H3,(H,17,19)(H,18,20)(H,21,22)
InChIKey
LSLXWOCIIFUZCQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Fraction Csp3
0.8
Rotatable bonds
8
H-bond acceptors
4
H-bond donors
4
Molar refractivity
83.99
TPSA
121.52
LogP / Solubility
WLOGP
0.34
MLOGP
0.31
XLogP3
-2.1
Consensus LogP
-0.48
Log S (ESOL)
-1.48
Class (ESOL)
Soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.95
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4
Customers Also Viewed
-
4-(S-Acetylthio)benzaldehyde
- CAS RN: 28130-89-4
- Product Code: starshine_CAS28130-89-4
- Purity/Analytical method: >99.0%
-
2,3-Dihydro-2-thioxo-3-methyl-7H-purin-6(1H)-one
- CAS RN: 28139-02-8
- Product Code: starshine_CAS28139-02-8
- Purity/Analytical method: >99.0%
-
-
-
-
